(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C11H14INO — CID 131111271

IUPAC(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cc(I)c2c(c1)CCC[C@H]2N
InChIInChI=1S/C11H14INO/c1-14-8-5-7-3-2-4-10(13)11(7)9(12)6-8/h5-6,10H,2-4,13H2,1H3/t10-/m1/s1
InChIKeyDMPUDFNOFJFFPT-SNVBAGLBSA-N
MW303.14 g/mol
LogP2.64
Rot. Bonds1

About (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 131111271) has the molecular formula C11H14INO and a molecular weight of 303.14 g/mol. Its IUPAC name is (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID131111271
Molecular FormulaC11H14INO
Molecular Weight303.14 g/mol
Exact Mass303.01
IUPAC Name(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cc(I)c2c(c1)CCC[C@H]2N
InChIInChI=1S/C11H14INO/c1-14-8-5-7-3-2-4-10(13)11(7)9(12)6-8/h5-6,10H,2-4,13H2,1H3/t10-/m1/s1
InChIKeyDMPUDFNOFJFFPT-SNVBAGLBSA-N
XLogP2.64
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.14
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(1R)-5-methoxy-7-methyl-2,3-dihydro-1H-inden-1-amine
CID 130682288
(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 131146254
1-chloro-7-methoxy-1,2,3,3a,4,5-hexahydroacenaphthylene
CID 63821201
(3R)-4-iodo-6-methoxy-2,3-dihydro-1-benzofuran-3-amine
CID 131002588
(1S)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71756873
(1R)-8-iodo-6-methyl-1,2,3,4-tetrahydronaphthalene-1,5-diamine
CID 130692932
(1R)-6-fluoro-8-iodo-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130706080
(1S)-8-bromo-7-iodo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 131151177
(1R)-6-chloro-8-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130624873
(6R)-1,3-dimethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine
CID 129392139
6,8-difluoro-1,2,3,4-tetrahydronaphthalen-1-amine
CID 55253125
6,8-dimethoxy-1-[methoxy(methylsulfanyl)methyl]-1,2,3,4-tetrahydronaphthalene
CID 10912995

Frequently Asked Questions

What is the IUPAC name of (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 131111271) is (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is COc1cc(I)c2c(c1)CCC[C@H]2N.
What is the InChIKey of (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is DMPUDFNOFJFFPT-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14INO/c1-14-8-5-7-3-2-4-10(13)11(7)9(12)6-8/h5-6,10H,2-4,13H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 303.14 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 131111271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).